Base information
| Cat. No. | |
| CAS No. | 77949-42-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H30O6 |
| Molecular Weight | 390.47 |
| Exact Mass | 390.204 |
| XLogP3 | 1.9756 |
| Mr | 100.976 |
| PSA | 93.06 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 62 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O[C@@H]1C[C@@H]2C[C@]3([C@@H]1[C@@]14CCCC([C@H]4[C@@H]([C@]3(OC1)O)O)(C)C)C(=O)C2=C |
